Geometry & MOs

Info

ID:	321743
PubChem CID:	126666918
Reduced:	FO3N7C18H20 (1)
Stoich.:	AB3C7D18E20 (1)
Weight, g/mol:	377.086784
ΔH_f, kcal/mol:	-65.73
Dipole, Da:	8.38
IP(EA), eV:	-9.1(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide

Drug info:

PubChemData

Smile

CN(CC1=CC(=CN=C1)F)C(=O)C2=C3C(=NN2)N=CN=C3N[C@@H]4CC[C@H]([C@H]4O)O

DOS

IR

Vibrations