Geometry & MOs

Info

ID:	350300
PubChem CID:	127277378
Reduced:	ON2C10H15 (2)
Stoich.:	AB2C10D15 (2)
Weight, g/mol:	361.200156
ΔH_f, kcal/mol:	-84.44
Dipole, Da:	6.04
IP(EA), eV:	-8.58(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[1-(1,4-dioxane-2-carbonyl)piperidin-3-yl]methyl]-3-(4-methylphenyl)urea

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)NCC2CCCN(C2)C(=O)C3CCCN3C

DOS

IR

Vibrations