Geometry & MOs

Info

ID:	336499
PubChem CID:	127255506
Reduced:	SCl2N3C7H17 (1)
Stoich.:	AB2C3D7E17 (1)
Weight, g/mol:	173.098669
ΔH_f, kcal/mol:	-61.49
Dipole, Da:	1.42
IP(EA), eV:	-9.13(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

piperidin-2-ylmethyl carbamimidothioate

Drug info:

PubChemData

Smile

C1CCNC(C1)CSC(=N)N.Cl.Cl

DOS

IR

Vibrations