Geometry & MOs

Info

ID:	281013
PubChem CID:	103852397
Reduced:	NO3C14H21 (1)
Stoich.:	AB3C14D21 (1)
Weight, g/mol:	356.07356
ΔH_f, kcal/mol:	-146.4
Dipole, Da:	5.0
IP(EA), eV:	-9.33(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-[2-[(1-hydroxy-4-methylpentan-3-yl)amino]-2-oxoethyl]benzamide

Drug info:

PubChemData

Smile

CC(C)C(CCO)NC(=O)CC1=CC(=CC=C1)O

DOS

IR

Vibrations