Geometry & MOs

Info

ID:	156906
PubChem CID:	56394855
Reduced:	N2O2C11H15 (2)
Stoich.:	A2B2C11D15 (2)
Weight, g/mol:	424.211055
ΔH_f, kcal/mol:	-153.26
Dipole, Da:	5.1
IP(EA), eV:	-8.66(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(N-methylanilino)propyl]-1-(3-methyl-4-nitrobenzoyl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)N1CCN(CC1)CC2=CC=C(C=C2)OC)N3C(=O)C4(CCCC4)NC3=O

DOS

IR

Vibrations