Geometry & MOs

Info

ID:	184928
PubChem CID:	77231141
Reduced:	ClNO2C10H12 (1)
Stoich.:	ABC2D10E12 (1)
Weight, g/mol:	2363.268535
ΔH_f, kcal/mol:	-76.53
Dipole, Da:	1.8
IP(EA), eV:	-9.53(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

COC(=O)C1=C(C=CC(=C1)Cl)CCN

DOS

IR

Vibrations