Geometry & MOs

Info

ID:	26162
PubChem CID:	639322
Reduced:	O3C20H34 (1)
Stoich.:	A3B20C34 (1)
Weight, g/mol:	183.079647
ΔH_f, kcal/mol:	-146.84
Dipole, Da:	1.28
IP(EA), eV:	-9.14(1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1H-pyrrol-2-yl)-1H-benzimidazole

Drug info:

PubChemData

Smile

C/C/1=C/CC[C@@]2([C@H](O2)[C@H](C[C@](/C=C/[C@@H](CC1)C(C)C)(C)O)O)C

DOS

IR

Vibrations