Geometry & MOs

Info

ID:	54317
PubChem CID:	16994371
Reduced:	O2N3C39H45 (1)
Stoich.:	A2B3C39D45 (1)
Weight, g/mol:	433.182398
ΔH_f, kcal/mol:	-18.86
Dipole, Da:	5.73
IP(EA), eV:	-8.77(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-[1-[(2-methoxyphenyl)methyl]benzimidazol-2-yl]pentyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(C)C)OCCCN2C3=CC=CC=C3N=C2CCCCCNC(=O)CC4=CC=C(C=C4)C5=CC=CC=C5

DOS

IR

Vibrations