Geometry & MOs

Info

ID:	305739
PubChem CID:	124967341
Reduced:	O2N5C19H25 (1)
Stoich.:	A2B5C19D25 (1)
Weight, g/mol:	305.210327
ΔH_f, kcal/mol:	-16.43
Dipole, Da:	6.08
IP(EA), eV:	-8.92(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-hydroxycyclohexyl)-1-[(3S)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CNC(=O)[C@H]1CN(CCN1CCC2=CC=CC=C2)C(=O)C3=CN(N=C3)C

DOS

IR

Vibrations