Geometry & MOs

Info

ID:	62324
PubChem CID:	26719237
Reduced:	FNOSH14C17 (1)
Stoich.:	ABCDE14F17 (1)
Weight, g/mol:	301.086956
ΔH_f, kcal/mol:	-38.03
Dipole, Da:	4.53
IP(EA), eV:	-8.76(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-5-chloro-N-(2,3-dimethylphenyl)-2,3-dihydro-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)NC(=O)C2=CC3=C(S2)C=CC(=C3)F)C

DOS

IR

Vibrations