Geometry & MOs

Info

ID:	367814
PubChem CID:	127325911
Reduced:	NO2C9H15 (2)
Stoich.:	AB2C9D15 (2)
Weight, g/mol:	382.211724
ΔH_f, kcal/mol:	-199.79
Dipole, Da:	2.34
IP(EA), eV:	-9.54(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[4-[[methyl-(4-methylpyrimidine-5-carbonyl)amino]methyl]cyclohexyl]pyrimidine-5-carboxamide

Drug info:

PubChemData

Smile

CN(CC1CCC(CC1)NC(=O)C2CCOC2)C(=O)C3CCOC3

DOS

IR

Vibrations