Geometry & MOs

Info

ID:	281057
PubChem CID:	103852647
Reduced:	BrNO2C13H16 (1)
Stoich.:	ABC2D13E16 (1)
Weight, g/mol:	324.08373
ΔH_f, kcal/mol:	-79.06
Dipole, Da:	5.47
IP(EA), eV:	-9.41(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N,3-dimethyl-N-(1-methylpiperidin-4-yl)benzamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(=O)NCC2CCCO2)Br

DOS

IR

Vibrations