Geometry & MOs

Info

ID:	302980
PubChem CID:	124489062
Reduced:	NO3C12H23 (1)
Stoich.:	AB3C12D23 (1)
Weight, g/mol:	315.104148
ΔH_f, kcal/mol:	-147.05
Dipole, Da:	1.17
IP(EA), eV:	-9.05(1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-3-methoxy-5-methylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CO[C@@H]1CCC[C@H](C1)OC[C@@H]2CNCCO2

DOS

IR

Vibrations