Geometry & MOs

Info

ID:	352246
PubChem CID:	127283328
Reduced:	ClON5C20H24 (1)
Stoich.:	ABC5D20E24 (1)
Weight, g/mol:	372.171689
ΔH_f, kcal/mol:	25.82
Dipole, Da:	4.86
IP(EA), eV:	-8.9(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-chlorophenyl)-cyclobutylmethyl]-2-(1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC(C1)C(C2=CC=C(C=C2)Cl)NC(=O)N3CCN(CC3)C4=NN=CC=C4

DOS

IR

Vibrations