Geometry & MOs

Info

ID:	329489
PubChem CID:	126737471
Reduced:	NOC11H21 (1)
Stoich.:	ABC11D21 (1)
Weight, g/mol:	432.23727
ΔH_f, kcal/mol:	-83.75
Dipole, Da:	4.22
IP(EA), eV:	-9.1(1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[3-[4-(cyclohexanecarbonylamino)-2-nitroanilino]cyclobutyl]carbamate

Drug info:

PubChemData

Smile

CCCC(C(C)C)N1CCCC1=O

DOS

IR

Vibrations