Geometry & MOs

Info

ID:	312760
PubChem CID:	126608374
Reduced:	O3H22C25 (1)
Stoich.:	A3B22C25 (1)
Weight, g/mol:	382.154209
ΔH_f, kcal/mol:	-65.22
Dipole, Da:	2.74
IP(EA), eV:	-8.83(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-amino-1-(2-cyclopropyl-3H-benzimidazol-5-yl)pyrazol-4-yl]-(1H-indol-2-yl)methanone

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)C1=CC2=CC=CC=C2C(=C1O)C3=C(C=CC4=CC=CC=C43)O

DOS

IR

Vibrations