Geometry & MOs

Info

ID:	345532
PubChem CID:	127269832
Reduced:	O3N5C16H23 (1)
Stoich.:	A3B5C16D23 (1)
Weight, g/mol:	315.194677
ΔH_f, kcal/mol:	-99.12
Dipole, Da:	4.29
IP(EA), eV:	-9.01(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-oxopiperidin-3-yl)-3-(4-phenylcyclohexyl)urea

Drug info:

PubChemData

Smile

C1CC(C(=O)NC1)NC(=O)NCC2=C(N=CC=C2)N3CCOCC3

DOS

IR

Vibrations