Geometry & MOs

Info

ID:	317322
PubChem CID:	126635621
Reduced:	NO3C18H21 (1)
Stoich.:	AB3C18D21 (1)
Weight, g/mol:	123.104799
ΔH_f, kcal/mol:	42.44
Dipole, Da:	4.78
IP(EA), eV:	-8.17(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1Z,3Z)-3-methylhexa-1,3-dienyl]methanimine

Drug info:

PubChemData

Smile

CN1CC23CC([C@H]4C5(C2)C3C1CC6=C5C(=C(C=C6)OC)O4)O

DOS

IR

Vibrations