Geometry & MOs

Info

ID:	292024
PubChem CID:	114147414
Reduced:	ClNOC16H22 (1)
Stoich.:	ABCD16E22 (1)
Weight, g/mol:	311.08848
ΔH_f, kcal/mol:	-73.33
Dipole, Da:	1.59
IP(EA), eV:	-9.36(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromopentyl)-2-(2,5-dimethylphenyl)acetamide

Drug info:

PubChemData

Smile

CC(CCCNC(=O)C1CCCC2=CC=CC=C12)Cl

DOS

IR

Vibrations