Geometry & MOs

Info

ID:	154571
PubChem CID:	56314036
Reduced:	OSN2C18H22 (1)
Stoich.:	ABC2D18E22 (1)
Weight, g/mol:	315.183444
ΔH_f, kcal/mol:	-13.95
Dipole, Da:	2.87
IP(EA), eV:	-9.18(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,4-dimethylcyclohexyl)-2-(6-methoxy-1-benzofuran-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)(C)NC(=O)/C=C/C2=NC3=CC=CC=C3S2

DOS

IR

Vibrations