Geometry & MOs

Info

ID:	181256
PubChem CID:	76722861
Reduced:	N4O6C23H32 (1)
Stoich.:	A4B6C23D32 (1)
Weight, g/mol:	401.231456
ΔH_f, kcal/mol:	-219.91
Dipole, Da:	5.04
IP(EA), eV:	-8.61(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(cyclopentylmethyl)-3-[formyl(phenylmethoxy)amino]propanoyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)NC(=O)NC(=O)C2CCCN2C(=O)C(CC3CCCC3)CN(C=O)O

DOS

IR

Vibrations