Geometry & MOs

Info

ID:	130368
PubChem CID:	51075744
Reduced:	ON2C8H11 (2)
Stoich.:	AB2C8D11 (2)
Weight, g/mol:	343.200825
ΔH_f, kcal/mol:	-13.59
Dipole, Da:	3.28
IP(EA), eV:	-8.71(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-3-(1,2,4-triazol-1-yl)propanamide

Drug info:

PubChemData

Smile

CN(C)C(CNC(=O)CN1C=CC=N1)C2=CC=CC=C2OC

DOS

IR

Vibrations