Geometry & MOs

Info

ID:	439074
PubChem CID:	135228837
Reduced:	N2O3C30H36 (1)
Stoich.:	A2B3C30D36 (1)
Weight, g/mol:	327.2926
ΔH_f, kcal/mol:	-47.01
Dipole, Da:	6.74
IP(EA), eV:	-7.45(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-2-[6-(4-cyclohexylpentan-2-yl)-3-methylcyclohexa-1,5-dien-1-yl]prop-1-enyl]ethanimine

Drug info:

PubChemData

Smile

CC(=C)C1=CN2C(CC3=CC(=C(C=C3C2=CC1=C)OC)C4=CN=C(C=C4)OCCOC)C(C)(C)C

DOS

IR

Vibrations