Geometry & MOs

Info

ID:	406868
PubChem CID:	135078812
Reduced:	INO2C13H16 (1)
Stoich.:	ABC2D13E16 (1)
Weight, g/mol:	666.358795
ΔH_f, kcal/mol:	-33.13
Dipole, Da:	1.94
IP(EA), eV:	-9.31(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C/C(=C/COC)/C(=O)N(C)C1=CC=CC=C1I

DOS

IR

Vibrations