Geometry & MOs

Info

ID:	358212
PubChem CID:	127295757
Reduced:	O3N5C18H33 (1)
Stoich.:	A3B5C18D33 (1)
Weight, g/mol:	297.205242
ΔH_f, kcal/mol:	-161.51
Dipole, Da:	3.82
IP(EA), eV:	-8.78(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-1-(oxan-3-ylmethyl)-3-(2-oxo-2-piperidin-1-ylethyl)urea

Drug info:

PubChemData

Smile

CC1CCCN(C1)CCNC(=O)NCCC(=O)N2CCN(CC2)C(=O)C

DOS

IR

Vibrations