Geometry & MOs

Info

ID:	448926
PubChem CID:	135294538
Reduced:	OSCl2N5C19H23 (1)
Stoich.:	ABC2D5E19F23 (1)
Weight, g/mol:	126.090546
ΔH_f, kcal/mol:	6.65
Dipole, Da:	7.73
IP(EA), eV:	-8.49(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-1-iminobut-2-en-2-yl]guanidine

Drug info:

PubChemData

Smile

COC1CCC2(C1)CCN(CC2)C3=CN=C(C(=N3)N)SC4=C(C(=NC=C4)Cl)Cl

DOS

IR

Vibrations