Geometry & MOs

Info

ID:	439094
PubChem CID:	135228857
Reduced:	N4C17H22 (1)
Stoich.:	A4B17C22 (1)
Weight, g/mol:	353.283098
ΔH_f, kcal/mol:	78.06
Dipole, Da:	3.28
IP(EA), eV:	-8.32(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(1-aminoethenyl)cyclohexyl]-3-[2-[(E)-1-(ethylideneamino)prop-1-en-2-yl]phenyl]butan-1-amine

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C2=CN=CN2CC(C)CN/C=C\N=C

DOS

IR

Vibrations