Geometry & MOs

Info

ID:	188622
PubChem CID:	77744069
Reduced:	SN2O3C18H34 (1)
Stoich.:	AB2C3D18E34 (1)
Weight, g/mol:	388.258674
ΔH_f, kcal/mol:	-209.68
Dipole, Da:	4.69
IP(EA), eV:	-8.76(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[[4-(dimethylamino)-5,6-dimethylpyrimidin-2-yl]amino]cyclohexyl]-6-oxopiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C(C(=O)O)NC(=O)NC1(CCCCC1)CSC(C)(C)C

DOS

IR

Vibrations