Geometry & MOs

Info

ID:	340251
PubChem CID:	127262262
Reduced:	Cl2N4O4H10C15 (1)
Stoich.:	A2B4C4D10E15 (1)
Weight, g/mol:	357.181919
ΔH_f, kcal/mol:	-12.3
Dipole, Da:	4.57
IP(EA), eV:	-9.46(-1.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propyl N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]carbamate;hydrochloride

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC(=O)OCN2C3=C(C(=CC(=C3)[N+](=O)[O-])Cl)C(=N2)Cl

DOS

IR

Vibrations