Geometry & MOs

Info

ID:	29869
PubChem CID:	837891
Reduced:	NOSC11H15 (1)
Stoich.:	ABCD11E15 (1)
Weight, g/mol:	255.02588
ΔH_f, kcal/mol:	-38.52
Dipole, Da:	4.18
IP(EA), eV:	-8.28(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(2-bromophenyl)-2-methylbutanamide

Drug info:

PubChemData

Smile

CC(C)C(=O)NC1=CC(=CC=C1)SC

DOS

IR

Vibrations