Geometry & MOs

Info

ID:	387685
PubChem CID:	134986435
Reduced:	O3C16H24 (1)
Stoich.:	A3B16C24 (1)
Weight, g/mol:	230.061076
ΔH_f, kcal/mol:	-116.88
Dipole, Da:	3.24
IP(EA), eV:	-8.37(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(Z)-1-chloro-1-isocyanoprop-1-en-2-yl]-3-methylindole

Drug info:

PubChemData

Smile

CC(CCC=C(C)C)OCOC1=CC=C(C=C1)OC

DOS

IR

Vibrations