Geometry & MOs

Info

ID:	71070
PubChem CID:	48414248
Reduced:	O2N4C19H20 (1)
Stoich.:	A2B4C19D20 (1)
Weight, g/mol:	388.17467
ΔH_f, kcal/mol:	-18.41
Dipole, Da:	4.59
IP(EA), eV:	-9.3(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-methyl-1H-pyrazol-4-yl)methyl]-5-oxo-1-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)CCNC(=O)C2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations