Geometry & MOs

Info

ID:	416203
PubChem CID:	135089213
Reduced:	SO2N4C11H20 (1)
Stoich.:	AB2C4D11E20 (1)
Weight, g/mol:	522.247835
ΔH_f, kcal/mol:	-62.52
Dipole, Da:	3.66
IP(EA), eV:	-8.55(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,7S)-13-methoxy-5-(2-piperidin-4-ylacetyl)-2,15-dioxa-5,8,18-triazatetracyclo[18.2.2.110,14.03,7]pentacosa-1(23),10(25),11,13,20(24),21-hexaene-9,17-dione

Drug info:

PubChemData

Smile

CCN(C)C1=NC(=NC=C1)NCCS(=O)(=O)CC

DOS

IR

Vibrations