Geometry & MOs

Info

ID:	330729
PubChem CID:	127248136
Reduced:	O2N3C24H27 (1)
Stoich.:	A2B3C24D27 (1)
Weight, g/mol:	404.184841
ΔH_f, kcal/mol:	14.06
Dipole, Da:	2.73
IP(EA), eV:	-9.19(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-3-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1-(2-pyridin-2-ylacetyl)pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1(CCN(C1)CCC2=CC=CC=C2)CC3=CC(=NO3)C4=CC=CC=C4

DOS

IR

Vibrations