Geometry & MOs

Info

ID:	337689
PubChem CID:	127258312
Reduced:	N3O4C17H17 (1)
Stoich.:	A3B4C17D17 (1)
Weight, g/mol:	247.168462
ΔH_f, kcal/mol:	-33.32
Dipole, Da:	11.66
IP(EA), eV:	-9.06(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E)-N,N-dimethyl-2-[methyl-(4-methylphenyl)hydrazinylidene]butanamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C(=C\2/C=C(C=CC2=O)[N+](=O)[O-])/NCCCC(=O)N

DOS

IR

Vibrations