Geometry & MOs

Info

ID:	139651
PubChem CID:	52574729
Reduced:	NO2C14H21 (1)
Stoich.:	AB2C14D21 (1)
Weight, g/mol:	251.134385
ΔH_f, kcal/mol:	-79.4
Dipole, Da:	5.0
IP(EA), eV:	-8.55(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-butan-2-yl]-N-methyl-4-(methylsulfanylmethyl)benzamide

Drug info:

PubChemData

Smile

CC[C@H](C)N(C)C(=O)COC1=CC=CC=C1C

DOS

IR

Vibrations