Geometry & MOs

Info

ID:	330726
PubChem CID:	127248133
Reduced:	O3N4C20H26 (1)
Stoich.:	A3B4C20D26 (1)
Weight, g/mol:	393.18009
ΔH_f, kcal/mol:	-48.42
Dipole, Da:	4.79
IP(EA), eV:	-9.13(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-(1-methylpyrazole-4-carbonyl)-3-[(3-phenyl-1,2-oxazol-5-yl)methyl]pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1(CCN(C1)C(=O)CN(C)C)CC2=CC(=NO2)C3=CC=CC=C3

DOS

IR

Vibrations