Geometry & MOs

Info

ID:	185997
PubChem CID:	77375954
Reduced:	NOC23H35 (1)
Stoich.:	ABC23D35 (1)
Weight, g/mol:	393.132471
ΔH_f, kcal/mol:	-43.03
Dipole, Da:	7.22
IP(EA), eV:	-9.6(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[7-(indole-1-carbonyl)-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-5-yl]but-2-enedioic acid

Drug info:

PubChemData

Smile

CCCCCC1CCC2C1(CCC3C2CCC4=NC(=O)C=CC34C)C

DOS

IR

Vibrations