Geometry & MOs

Info

ID:	149296
PubChem CID:	53788968
Reduced:	FSN2O3C26H29 (1)
Stoich.:	ABC2D3E26F29 (1)
Weight, g/mol:	413.199094
ΔH_f, kcal/mol:	-102.85
Dipole, Da:	2.93
IP(EA), eV:	-8.12(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-4-[3-[4-(4-phenoxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]prop-1-enyl]phenol

Drug info:

PubChemData

Smile

CN1CC=CCC1C2=CN(C3=C2C=C(C=C3)OC4CCCCC4)S(=O)(=O)C5=CC=C(C=C5)F

DOS

IR

Vibrations