Geometry & MOs

Info

ID:	370596
PubChem CID:	127339734
Reduced:	O2N5C19H25 (1)
Stoich.:	A2B5C19D25 (1)
Weight, g/mol:	332.221226
ΔH_f, kcal/mol:	-39.48
Dipole, Da:	2.31
IP(EA), eV:	-8.8(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-tert-butyl-4-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC(=O)NCC(=O)N2CCC(CC2)C3=CN(N=C3)C

DOS

IR

Vibrations