Geometry & MOs

Info

ID:	369425
PubChem CID:	127333362
Reduced:	ON3C15H23 (1)
Stoich.:	AB3C15D23 (1)
Weight, g/mol:	297.162332
ΔH_f, kcal/mol:	-43.59
Dipole, Da:	4.04
IP(EA), eV:	-8.57(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-methyl-1-[(1-methylpiperidin-3-yl)methyl]urea

Drug info:

PubChemData

Smile

CC1CN(CCN1C(=O)NC2=CC(=CC(=C2)C)C)C

DOS

IR

Vibrations