Geometry & MOs

Info

ID:	404647
PubChem CID:	135068408
Reduced:	SiO5C23H38 (1)
Stoich.:	AB5C23D38 (1)
Weight, g/mol:	289.107834
ΔH_f, kcal/mol:	-257.81
Dipole, Da:	2.93
IP(EA), eV:	-8.66(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1Z)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)ethyl]-1-[4-(trifluoromethyl)phenyl]methanimine

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OC/C=C\1/C[C@H](O[C@H](C1)COCC2=CC=C(C=C2)OC)CO

DOS

IR

Vibrations