Geometry & MOs

Info

ID:	295370
PubChem CID:	117527528
Reduced:	N3C16H19 (1)
Stoich.:	A3B16C19 (1)
Weight, g/mol:	244.157563
ΔH_f, kcal/mol:	69.42
Dipole, Da:	6.93
IP(EA), eV:	-8.94(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(1-methyl-2-propan-2-ylbenzimidazol-5-yl)cyclopropyl]methanol

Drug info:

PubChemData

Smile

CC(C)CC1=NC2=C(N1C)C=CC(=C2)C3(CC3)C#N

DOS

IR

Vibrations