Geometry & MOs

Info

ID:	131895
PubChem CID:	51275409
Reduced:	N3O7H15C17 (1)
Stoich.:	A3B7C15D17 (1)
Weight, g/mol:	342.121572
ΔH_f, kcal/mol:	-128.6
Dipole, Da:	8.6
IP(EA), eV:	-9.17(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(2-methoxy-5-methylbenzoyl)-2,3-dihydro-1,4-benzodioxine-6-carbohydrazide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NNC(=O)C2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations