Geometry & MOs

Info

ID:	275992
PubChem CID:	103819794
Reduced:	BrNO2C17H26 (1)
Stoich.:	ABC2D17E26 (1)
Weight, g/mol:	358.05282
ΔH_f, kcal/mol:	-109.3
Dipole, Da:	1.67
IP(EA), eV:	-9.55(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-(3-ethyl-2-hydroxypentyl)-5-nitrobenzamide

Drug info:

PubChemData

Smile

CCC(CC)C(CNC(=O)CC(C)C1=CC=C(C=C1)Br)O

DOS

IR

Vibrations