Geometry & MOs

Info

ID:	263833
PubChem CID:	103401109
Reduced:	ClNOSC17H22 (1)
Stoich.:	ABCDE17F22 (1)
Weight, g/mol:	384.96512
ΔH_f, kcal/mol:	-29.26
Dipole, Da:	2.52
IP(EA), eV:	-8.53(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-6-[(3-chloro-4-methylthiophen-2-yl)-(methylamino)methyl]-1,3-dihydrobenzimidazol-2-one

Drug info:

PubChemData

Smile

CCNC(C1=C(C=CC(=C1)C)OCC)C2=C(C(=CS2)C)Cl

DOS

IR

Vibrations