Geometry & MOs

Info

ID:	311960
PubChem CID:	126599442
Reduced:	NPSO5C7H16 (1)
Stoich.:	ABCD5E7F16 (1)
Weight, g/mol:	293.164046
ΔH_f, kcal/mol:	-259.48
Dipole, Da:	2.17
IP(EA), eV:	-10.01(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1Z,3E)-4-[4-[(E)-2-(1H-imidazol-5-yl)ethenyl]phenyl]-2-N-methyl-2-N-(methylideneamino)buta-1,3-diene-1,2-diamine

Drug info:

PubChemData

Smile

CCOP(=O)(C(=N)S(=O)(=O)CC)OCC

DOS

IR

Vibrations