Geometry & MOs

Info

ID:	240882
PubChem CID:	93618031
Reduced:	N2O4C19H26 (1)
Stoich.:	A2B4C19D26 (1)
Weight, g/mol:	329.173942
ΔH_f, kcal/mol:	-166.67
Dipole, Da:	2.67
IP(EA), eV:	-8.96(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]methyl]-3-pyrazol-1-ylpropanamide

Drug info:

PubChemData

Smile

CC(=O)N1CCC[C@H]1C(=O)NCC2=CC=C(C=C2)OC[C@H]3CCCO3

DOS

IR

Vibrations