Geometry & MOs

Info

ID:	345858
PubChem CID:	127270158
Reduced:	SN4O4C17H26 (1)
Stoich.:	AB4C4D17E26 (1)
Weight, g/mol:	338.152495
ΔH_f, kcal/mol:	-185.19
Dipole, Da:	6.35
IP(EA), eV:	-8.74(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(tetrazol-1-yl)-N-[4-(thiomorpholine-4-carbonyl)cyclohexyl]acetamide

Drug info:

PubChemData

Smile

CN1CC(=O)N(C1=O)CC(=O)NC2CCC(CC2)C(=O)N3CCSCC3

DOS

IR

Vibrations