Geometry & MOs

Info

ID:	40878
PubChem CID:	8144896
Reduced:	N3O4C15H25 (1)
Stoich.:	A3B4C15D25 (1)
Weight, g/mol:	309.147727
ΔH_f, kcal/mol:	-199.21
Dipole, Da:	2.19
IP(EA), eV:	-9.14(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-anilino-N'-[(6-oxo-5-prop-2-enylcyclohexa-2,4-dien-1-ylidene)methyl]acetohydrazide

Drug info:

PubChemData

Smile

CCC[C@@H]1C(=O)N(C(=O)N1)CN2CCC(CC2)C(=O)OCC

DOS

IR

Vibrations