Geometry & MOs

Info

ID:	197274
PubChem CID:	78945732
Reduced:	SO2N4C8H8 (1)
Stoich.:	AB2C4D8E8 (1)
Weight, g/mol:	341.98652
ΔH_f, kcal/mol:	16.89
Dipole, Da:	4.83
IP(EA), eV:	-10.2(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-iodobenzoyl)morpholine-2-carbonitrile

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)C2=CN=NS2)C#N

DOS

IR

Vibrations