Geometry & MOs

Info

ID:	350319
PubChem CID:	127277397
Reduced:	N3O3C19H33 (1)
Stoich.:	A3B3C19D33 (1)
Weight, g/mol:	295.153206
ΔH_f, kcal/mol:	-174.51
Dipole, Da:	3.79
IP(EA), eV:	-9.12(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyclohexyl-2-hydroxyethyl)-1-methyl-2,4-dioxopyrimidine-5-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)C(CNC(=O)C2CCCN(C2)C(=O)N3CCCC3)O

DOS

IR

Vibrations