Geometry & MOs

Info

ID:	339691
PubChem CID:	127261693
Reduced:	N4H18C19 (1)
Stoich.:	A4B18C19 (1)
Weight, g/mol:	235.114319
ΔH_f, kcal/mol:	117.87
Dipole, Da:	1.81
IP(EA), eV:	-8.24(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N'-[(Z)-1-phenylbutylideneamino]carbamimidothioate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N/N=C(\N)/N(C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations