Geometry & MOs

Info

ID:	298673
PubChem CID:	117653819
Reduced:	NO4C17H19 (1)
Stoich.:	AB4C17D19 (1)
Weight, g/mol:	350.13789
ΔH_f, kcal/mol:	-150.72
Dipole, Da:	9.33
IP(EA), eV:	-9.06(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(N-aminoanilino)-N'-benzoyl-2H-pyran-2-carbohydrazide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2C(=C(N(C(=C2C(=O)O)C)C)C)C(=O)O

DOS

IR

Vibrations