Geometry & MOs

Info

ID:	209405
PubChem CID:	80666195
Reduced:	BrNO2C12H16 (1)
Stoich.:	ABC2D12E16 (1)
Weight, g/mol:	270.03678
ΔH_f, kcal/mol:	-81.92
Dipole, Da:	4.59
IP(EA), eV:	-9.27(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromoethyl)-N-propan-2-ylpyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)N(CCBr)C(=O)C1=CC(=CC=C1)O

DOS

IR

Vibrations