Geometry & MOs

Info

ID:	356876
PubChem CID:	127292480
Reduced:	O2N5C22H33 (1)
Stoich.:	A2B5C22D33 (1)
Weight, g/mol:	267.194677
ΔH_f, kcal/mol:	-77.17
Dipole, Da:	4.9
IP(EA), eV:	-8.84(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(oxan-3-yl)-3-(1-prop-2-enylpiperidin-4-yl)urea

Drug info:

PubChemData

Smile

CC(=C)CN1CCC(CC1)NC(=O)N2CCC(CC2)NC(=O)NC3=CC=CC=C3

DOS

IR

Vibrations