Geometry & MOs

Info

ID:	352091
PubChem CID:	127283159
Reduced:	SO2N3C19H31 (1)
Stoich.:	AB2C3D19E31 (1)
Weight, g/mol:	365.213698
ΔH_f, kcal/mol:	-100.15
Dipole, Da:	2.1
IP(EA), eV:	-8.83(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-hydroxycyclohexyl)methyl]-3-[[1-(thiophen-2-ylmethyl)piperidin-3-yl]methyl]urea

Drug info:

PubChemData

Smile

C1CCC(CC1)(CNC(=O)NCC2CCN(CC2)CC3=CC=CS3)O

DOS

IR

Vibrations