Geometry & MOs

Info

ID:	348403
PubChem CID:	127273496
Reduced:	NO2C9H12 (2)
Stoich.:	AB2C9D12 (2)
Weight, g/mol:	385.193632
ΔH_f, kcal/mol:	-150.85
Dipole, Da:	4.45
IP(EA), eV:	-9.53(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-(4-methylpiperidin-1-yl)pyridin-3-yl]-[4-(4-methyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1(CN(CCO1)C(=O)[C@H]2COCC(=O)N2CC3=CC=CC=C3)C

DOS

IR

Vibrations