Geometry & MOs

Info

ID:	439019
PubChem CID:	135228781
Reduced:	ON4C29H36 (1)
Stoich.:	AB4C29D36 (1)
Weight, g/mol:	369.266779
ΔH_f, kcal/mol:	40.46
Dipole, Da:	3.05
IP(EA), eV:	-7.68(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(E)-3-(1-ethoxyethenyl)-2-methylidenepent-3-enyl]-7-methoxy-6-methyl-3-propan-2-yl-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

CC(C)CCC1=CC(=C(C=C1C2=CC(=C)C(=CN2)C(=C)C)OC)C3=CN=C(N=C3)NC4CCC4

DOS

IR

Vibrations