Geometry & MOs

Info

ID:	442656
PubChem CID:	135253794
Reduced:	FOSN4H11C14 (1)
Stoich.:	ABCD4E11F14 (1)
Weight, g/mol:	209.21435
ΔH_f, kcal/mol:	36.41
Dipole, Da:	3.31
IP(EA), eV:	-8.53(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-4,4-dimethylpent-2-en-3-yl]-N-methylcyclohexanamine

Drug info:

PubChemData

Smile

C\1COC2=C(C=CN=C2/C1=N\NC(=S)C3=CC=CC=N3)F

DOS

IR

Vibrations