Geometry & MOs

Info

ID:	230393
PubChem CID:	87570777
Reduced:	CSN2O2H4 (1)
Stoich.:	ABC2D2E4 (1)
Weight, g/mol:	557.303576
ΔH_f, kcal/mol:	-47.82
Dipole, Da:	3.27
IP(EA), eV:	-9.64(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-[(3R)-3-[4-[methoxycarbamoyl(thiophen-3-ylmethyl)amino]piperidin-1-yl]butyl]-2,6-dimethyl-1-N-propan-2-ylbenzene-1,4-dicarboxamide

Drug info:

PubChemData

Smile

C(=O)(N)N(O)S

DOS

IR

Vibrations