Geometry & MOs

Info

ID:	315148
PubChem CID:	126624598
Reduced:	N3O4C21H27 (1)
Stoich.:	A3B4C21D27 (1)
Weight, g/mol:	551.358388
ΔH_f, kcal/mol:	-153.92
Dipole, Da:	12.84
IP(EA), eV:	-9.11(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-bis[2-(butylamino)butyl]-2-[(2Z)-2-(5-cyano-4-methyl-2,6-dioxopyridin-3-ylidene)hydrazinyl]benzamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=NN(C(=O)C1)C2=CC=C(C=C2)C(=O)NC3CCCC(C3)C(=O)O

DOS

IR

Vibrations