Geometry & MOs

Info

ID:	139638
PubChem CID:	52573504
Reduced:	ClNO3C22H26 (1)
Stoich.:	ABC3D22E26 (1)
Weight, g/mol:	353.181336
ΔH_f, kcal/mol:	-91.25
Dipole, Da:	6.07
IP(EA), eV:	-9.02(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-4-(methylsulfanylmethyl)-N-(4-phenylcyclohexyl)benzamide

Drug info:

PubChemData

Smile

CN(C1CCC(CC1)C2=CC=CC=C2)C(=O)C3=CC(=C(C(=C3)Cl)OC)OC

DOS

IR

Vibrations