Geometry & MOs

Info

ID:	281626
PubChem CID:	103914138
Reduced:	O2N3C13H19 (1)
Stoich.:	A2B3C13D19 (1)
Weight, g/mol:	314.06299
ΔH_f, kcal/mol:	-76.09
Dipole, Da:	5.77
IP(EA), eV:	-8.76(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(3-bromophenyl)-2-hydroxyethyl]amino]-3-methylbutanamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N)NCC(=O)NC1=CC=CC=C1

DOS

IR

Vibrations