Geometry & MOs

Info

ID:	36629
PubChem CID:	8010088
Reduced:	SO2N4C16H24 (1)
Stoich.:	AB2C4D16E24 (1)
Weight, g/mol:	306.187818
ΔH_f, kcal/mol:	-88.91
Dipole, Da:	4.73
IP(EA), eV:	-9.05(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(dimethylamino)ethyl]-3-(4-piperidin-1-ylphenyl)thiourea

Drug info:

PubChemData

Smile

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CSC3CCCC3)C

DOS

IR

Vibrations