Geometry & MOs

Info

ID:	350171
PubChem CID:	127277249
Reduced:	O2N5C22H29 (1)
Stoich.:	A2B5C22D29 (1)
Weight, g/mol:	335.232125
ΔH_f, kcal/mol:	-55.2
Dipole, Da:	9.96
IP(EA), eV:	-9.08(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2-methoxyethyl)pyrazol-4-yl]-2-(piperidin-1-ylmethyl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=O)C=C(N1)C2=CC=C(C=C2)NC(=O)N3CCCC3CN4CCCCC4

DOS

IR

Vibrations