Geometry & MOs

Info

ID:	140164
PubChem CID:	52656840
Reduced:	O3N5C20H39 (1)
Stoich.:	A3B5C20D39 (1)
Weight, g/mol:	354.157957
ΔH_f, kcal/mol:	-168.87
Dipole, Da:	2.95
IP(EA), eV:	-8.67(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-cyclopentyloxyphenyl)methyl]-2-methyl-3-nitrobenzamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)CCCCNC(=O)N2CCN(CC2)C(=O)OC(C)(C)C

DOS

IR

Vibrations