Geometry & MOs

Info

ID:	123399
PubChem CID:	50845712
Reduced:	O3N5C24H31 (1)
Stoich.:	A3B5C24D31 (1)
Weight, g/mol:	391.064507
ΔH_f, kcal/mol:	-115.93
Dipole, Da:	6.61
IP(EA), eV:	-8.32(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-[(3,5-dimethoxyphenyl)methyl]-3-methoxy-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCNC(=O)C1CCCN(C1)C(=O)NC2=CC=C(C=C2)NC(=O)NC3=C(C=C(C=C3)C)C

DOS

IR

Vibrations