Geometry & MOs

Info

ID:	187381
PubChem CID:	77567601
Reduced:	O2N4C23H32 (1)
Stoich.:	A2B4C23D32 (1)
Weight, g/mol:	344.196074
ΔH_f, kcal/mol:	-42.12
Dipole, Da:	3.28
IP(EA), eV:	-8.72(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(3-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indazol-6-yl)-4-N-(oxetan-3-yl)furo[3,2-d]pyrimidine-2,4-diamine

Drug info:

PubChemData

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CCN(CC)C1=NC2=CC=CC=C2C(=O)N1NC(=O)CC3CCC4CC3C4(C)C

DOS

IR

Vibrations