Geometry & MOs

Info

ID:	368349
PubChem CID:	127327944
Reduced:	O2N3C20H31 (1)
Stoich.:	A2B3C20D31 (1)
Weight, g/mol:	319.237211
ΔH_f, kcal/mol:	-97.63
Dipole, Da:	4.74
IP(EA), eV:	-8.49(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-methylpyrazol-4-yl)-N-[(1-propylpyrrolidin-3-yl)methyl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1(CCCCC1)NC(=O)NC2=CC=C(C=C2)CCN3CCOCC3

DOS

IR

Vibrations