Geometry & MOs

Info

ID:	276276
PubChem CID:	103821893
Reduced:	N2O3C18H30 (1)
Stoich.:	A2B3C18D30 (1)
Weight, g/mol:	341.150619
ΔH_f, kcal/mol:	-159.51
Dipole, Da:	1.35
IP(EA), eV:	-8.29(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[3-[4-chloro-3-(methylcarbamoyl)anilino]propyl]carbamate

Drug info:

PubChemData

Smile

CC(C)COC1=CC=CC(=C1)NCCCNC(=O)OC(C)(C)C

DOS

IR

Vibrations