Geometry & MOs

Info

ID:	311388
PubChem CID:	126591281
Reduced:	ClINOC7H7 (1)
Stoich.:	ABCDE7F7 (1)
Weight, g/mol:	218.178299
ΔH_f, kcal/mol:	-7.0
Dipole, Da:	3.56
IP(EA), eV:	-9.8(-2.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-2-ethenyl-4-(2-methylhexylimino)pent-2-enenitrile

Drug info:

PubChemData

Smile

CC1=CC(=NC(=C1)Cl)COI

DOS

IR

Vibrations