Geometry & MOs

Info

ID:	351036
PubChem CID:	127279473
Reduced:	N2O3C15H20 (1)
Stoich.:	A2B3C15D20 (1)
Weight, g/mol:	325.19026
ΔH_f, kcal/mol:	-114.43
Dipole, Da:	5.9
IP(EA), eV:	-8.46(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclobutyl-N-[3-(1,2,4-triazol-1-ylmethyl)phenyl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1(CCCN1C(=O)NC2=C3C(=CC=C2)OCCO3)C

DOS

IR

Vibrations