Geometry & MOs

Info

ID:	311637
PubChem CID:	126595912
Reduced:	NOC11H17 (1)
Stoich.:	ABC11D17 (1)
Weight, g/mol:	379.146681
ΔH_f, kcal/mol:	-32.16
Dipole, Da:	2.85
IP(EA), eV:	-7.86(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-methoxyphenyl)methyl]-2-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrrolo[3,2-d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)N(C)C)C

DOS

IR

Vibrations