Geometry & MOs

Info

ID:	364205
PubChem CID:	127314508
Reduced:	O2N3C21H27 (1)
Stoich.:	A2B3C21D27 (1)
Weight, g/mol:	365.185175
ΔH_f, kcal/mol:	-70.87
Dipole, Da:	7.86
IP(EA), eV:	-8.64(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-5-carbonyl)cinnolin-4-one

Drug info:

PubChemData

Smile

CC(C)C1=NC2=C(N1C)CCN(C2)C(=O)C3=C(C=C4CCCCC4=C3)O

DOS

IR

Vibrations