Geometry & MOs

Info

ID:	179435
PubChem CID:	76483019
Reduced:	NO4C29H39 (1)
Stoich.:	AB4C29D39 (1)
Weight, g/mol:	283.168462
ΔH_f, kcal/mol:	-169.71
Dipole, Da:	2.95
IP(EA), eV:	-8.12(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-3-methyl-5-(4-methylphenyl)-4-pyrazolidin-4-ylpyridine

Drug info:

PubChemData

Smile

CC12CC(C3=C4CCC5(CC4CC(C3C1CCC2=O)CO)OCCO5)C6=CC=C(C=C6)N(C)C

DOS

IR

Vibrations