Geometry & MOs

Info

ID:	276283
PubChem CID:	103821932
Reduced:	N2O3C17H28 (1)
Stoich.:	A2B3C17D28 (1)
Weight, g/mol:	323.184506
ΔH_f, kcal/mol:	-148.78
Dipole, Da:	2.96
IP(EA), eV:	-8.77(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[3-(4,5-dimethyl-2-nitroanilino)propyl]carbamate

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OCCNCCCNC(=O)OC(C)(C)C

DOS

IR

Vibrations