Geometry & MOs

Info

ID:	322115
PubChem CID:	126668709
Reduced:	O3N4H6C7 (1)
Stoich.:	A3B4C6D7 (1)
Weight, g/mol:	535.175262
ΔH_f, kcal/mol:	-54.42
Dipole, Da:	9.18
IP(EA), eV:	-9.86(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-[2-(4-methoxybutyl)-4-(trifluoromethyl)phenyl]-4-methyl-N-pyridazin-3-yl-2,3-dihydrochromene-7-sulfonamide

Drug info:

PubChemData

Smile

C1=CN(C2=NC=C(C(=O)N21)C(=O)O)N

DOS

IR

Vibrations