Geometry & MOs

Info

ID:	192519
PubChem CID:	78279457
Reduced:	N4O4C21H25 (1)
Stoich.:	A4B4C21D25 (1)
Weight, g/mol:	394.180053
ΔH_f, kcal/mol:	-100.54
Dipole, Da:	6.19
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.995402
Charge, e:	1

Chem-info

IUPAC name:

[2-[[4-(diethylsulfamoyl)benzoyl]amino]-1-(furan-2-yl)ethyl]-dimethylazanium

Drug info:

PubChemData

Smile

C[NH+](C)C(CNC(=O)CN1C(=O)C2(CCC3=CC=CC=C32)NC1=O)C4=CC=CO4

DOS

IR

Vibrations