Geometry & MOs

Info

ID:	272571
PubChem CID:	103748077
Reduced:	BrNOC14H20 (1)
Stoich.:	ABCD14E20 (1)
Weight, g/mol:	361.05388
ΔH_f, kcal/mol:	-34.57
Dipole, Da:	1.88
IP(EA), eV:	-9.16(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethyl-4-hydroxybutyl)-2-iodo-3-methylbenzamide

Drug info:

PubChemData

Smile

CC(CCOC)NC1CCC2=C1C=CC=C2Br

DOS

IR

Vibrations