Geometry & MOs

Info

ID:	169189
PubChem CID:	75072631
Reduced:	O3N5C30H41 (1)
Stoich.:	A3B5C30D41 (1)
Weight, g/mol:	374.185509
ΔH_f, kcal/mol:	-43.88
Dipole, Da:	7.05
IP(EA), eV:	-8.87(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-7-[1-(3-methylmorpholin-4-yl)phthalazin-6-yl]-1H-indazol-3-amine

Drug info:

PubChemData

Smile

CC(CC1CCC(O1)C(C)C(=O)N2CCN(CC2)CC3CCCO3)N4C=C(N=N4)C#CCC5=CC=CC=C5

DOS

IR

Vibrations