Geometry & MOs

Info

ID:	291750
PubChem CID:	113467809
Reduced:	NO2C6H9 (2)
Stoich.:	AB2C6D9 (2)
Weight, g/mol:	378.96055
ΔH_f, kcal/mol:	-152.17
Dipole, Da:	6.81
IP(EA), eV:	-8.88(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromoethyl)-2-(4-bromophenyl)-N-(2-methoxyethyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)N(CCO)CCOC)C(=O)O

DOS

IR

Vibrations