Geometry & MOs

Info

ID:	224365
PubChem CID:	85342113
Reduced:	ClN2O7C15H15 (1)
Stoich.:	AB2C7D15E15 (1)
Weight, g/mol:	369.142925
ΔH_f, kcal/mol:	-213.85
Dipole, Da:	1.92
IP(EA), eV:	-9.06(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(=O)OC1=C(C=C2C(C3(C(=O)NCC(=O)N3OC)OC2=C1)OC)Cl

DOS

IR

Vibrations