Geometry & MOs

Info

ID:	45450
PubChem CID:	10513602
Reduced:	N3C14H19 (1)
Stoich.:	A3B14C19 (1)
Weight, g/mol:	230.08777
ΔH_f, kcal/mol:	45.11
Dipole, Da:	5.02
IP(EA), eV:	-8.11(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2Z)-2-(6,7-dihydro-5H-1-benzothiophen-4-ylidene)ethyl]imidazole

Drug info:

PubChemData

Smile

CN1C=CN=C1CCC2=CC=C(C=C2)N(C)C

DOS

IR

Vibrations