Geometry & MOs

Info

ID:	326620
PubChem CID:	126687900
Reduced:	ON2C9H12 (1)
Stoich.:	AB2C9D12 (1)
Weight, g/mol:	263.131014
ΔH_f, kcal/mol:	-2.92
Dipole, Da:	4.24
IP(EA), eV:	-8.62(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(1-phenylethenyl)-2,3-dihydro-1H-pyrrolizin-1-yl]propa-1,2-dien-1-ol

Drug info:

PubChemData

Smile

CNC1=CC=CC(=C1C=N)CO

DOS

IR

Vibrations