Geometry & MOs

Info

ID:	280338
PubChem CID:	103848496
Reduced:	BrON2C15H21 (1)
Stoich.:	ABC2D15E21 (1)
Weight, g/mol:	317.04153
ΔH_f, kcal/mol:	-16.17
Dipole, Da:	4.66
IP(EA), eV:	-8.74(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-4-methyl-N-[(1R)-1-phenylethyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(=O)NCC(C)N(C)C2CC2)Br

DOS

IR

Vibrations