Geometry & MOs

Info

ID:	153107
PubChem CID:	56312241
Reduced:	SO3N5C21H23 (1)
Stoich.:	AB3C5D21E23 (1)
Weight, g/mol:	354.151433
ΔH_f, kcal/mol:	-20.19
Dipole, Da:	5.13
IP(EA), eV:	-8.3(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]thiophene-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)C2CCN(CC2)CC(=O)NC3=CC=C(C=C3)NC(=O)C4=CC=CS4

DOS

IR

Vibrations