Geometry & MOs

Info

ID:	445954
PubChem CID:	135270019
Reduced:	SO2N5C21H23 (1)
Stoich.:	AB2C5D21E23 (1)
Weight, g/mol:	177.15175
ΔH_f, kcal/mol:	81.41
Dipole, Da:	4.24
IP(EA), eV:	-8.12(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E,5Z,7Z)-4-ethylidene-N-methylnona-5,7-dien-3-imine

Drug info:

PubChemData

Smile

CCS(=O)C1=CC=CC=C1C(=N/C(=C(/N)\N=C)/C2=NN=C(O2)C3=CCCC=C3)C

DOS

IR

Vibrations