Geometry & MOs

Info

ID:	217333
PubChem CID:	85087636
Reduced:	ON3C22H31 (1)
Stoich.:	AB3C22D31 (1)
Weight, g/mol:	353.181336
ΔH_f, kcal/mol:	-35.32
Dipole, Da:	4.01
IP(EA), eV:	-8.85(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methylsulfanyl-N-[[2-(2-phenylethyl)cyclopentyl]methyl]benzamide

Drug info:

PubChemData

Smile

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)NCC(CC2=CC=CC=C2)N

DOS

IR

Vibrations