Geometry & MOs

Info

ID:	64041
PubChem CID:	26759742
Reduced:	N2O5C18H24 (1)
Stoich.:	A2B5C18D24 (1)
Weight, g/mol:	464.089821
ΔH_f, kcal/mol:	-219.61
Dipole, Da:	2.89
IP(EA), eV:	-9.06(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1,3-dithiolan-2-yl)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)benzamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC(=O)NC1CCCC1)OC(=O)CC2=CC=C(C=C2)OC

DOS

IR

Vibrations