Geometry & MOs

Info

ID:	155580
PubChem CID:	56366018
Reduced:	N2O3C27H36 (1)
Stoich.:	A2B3C27D36 (1)
Weight, g/mol:	470.172083
ΔH_f, kcal/mol:	-111.99
Dipole, Da:	5.88
IP(EA), eV:	-8.9(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(E)-3-(4-chloro-3-nitrophenyl)prop-2-enoyl]amino]-N-(3-pyrrolidin-1-ylphenyl)pentanamide

Drug info:

PubChemData

Smile

CCCN(C1CCN(CC1)C(=O)C2=CC=CC=C2)C(=O)COC3=CC(=C(C=C3)C(C)C)C

DOS

IR

Vibrations