Geometry & MOs

Info

ID:	425083
PubChem CID:	135125125
Reduced:	BrSF3N3O4C14H15 (1)
Stoich.:	ABC3D3E4F14G15 (1)
Weight, g/mol:	363.158292
ΔH_f, kcal/mol:	-244.56
Dipole, Da:	4.02
IP(EA), eV:	-9.17(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(1,3-benzoxazol-5-yl)spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxamide

Drug info:

PubChemData

Smile

CC1(CS(N(C(=N1)NC(=O)O)C)(O)O)C2=C(C(=CC(=C2)/C=C(\F)/Br)F)F

DOS

IR

Vibrations