Geometry & MOs

Info

ID:	124283
PubChem CID:	50877035
Reduced:	O3N4H16C20 (1)
Stoich.:	A3B4C16D20 (1)
Weight, g/mol:	216.126263
ΔH_f, kcal/mol:	-24.65
Dipole, Da:	7.6
IP(EA), eV:	-9.6(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-butan-2-ylbenzimidazol-2-yl)ethanone

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC(NC(=O)N2C=CN=C2)N3C(=O)C4=CC=CC=C4C3=O

DOS

IR

Vibrations