Geometry & MOs

Info

ID:	327537
PubChem CID:	126690285
Reduced:	NOC7H11 (1)
Stoich.:	ABC7D11 (1)
Weight, g/mol:	289.18305
ΔH_f, kcal/mol:	-3.45
Dipole, Da:	3.43
IP(EA), eV:	-8.76(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethenyl-3,3-diethyl-7-phenyl-4H-isoquinoline

Drug info:

PubChemData

Smile

CCN=C/C(=C\C=C)/O

DOS

IR

Vibrations