Geometry & MOs

Info

ID:	308643
PubChem CID:	126497240
Reduced:	NC8H15 (1)
Stoich.:	AB8C15 (1)
Weight, g/mol:	202.081622
ΔH_f, kcal/mol:	-4.83
Dipole, Da:	2.1
IP(EA), eV:	-9.02(2.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z)-3-ethylidene-2-propan-2-ylidene-1-benzothiophene

Drug info:

PubChemData

Smile

C[C@H]1CCNC2(C1)CC2

DOS

IR

Vibrations