Geometry & MOs

Info

ID:	223435
PubChem CID:	85335041
Reduced:	O4N5H15C17 (1)
Stoich.:	A4B5C15D17 (1)
Weight, g/mol:	354.136176
ΔH_f, kcal/mol:	-35.42
Dipole, Da:	4.96
IP(EA), eV:	-9.38(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(2,5-dimethylpyrrolidin-1-yl)-2-hydroxypropyl]-2,1,3-benzoxadiazole-4-sulfonamide

Drug info:

PubChemData

Smile

COC1=CC2=NC(=O)N(C(=O)C2=CC1C3=CN=CO3)CCN4C=CN=C4

DOS

IR

Vibrations