Geometry & MOs

Info

ID:	185055
PubChem CID:	77248208
Reduced:	ClO2N4C12H13 (1)
Stoich.:	AB2C4D12E13 (1)
Weight, g/mol:	320.209993
ΔH_f, kcal/mol:	-23.45
Dipole, Da:	5.23
IP(EA), eV:	-9.87(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3,5-dimethyl-1-[1-(4-methylphenyl)ethylamino]-1-oxohexan-2-yl] carbamate

Drug info:

PubChemData

Smile

C1CNC(=O)CC1C2=NC(=NO2)C3=CN=CC=C3.Cl

DOS

IR

Vibrations