Geometry & MOs

Info

ID:	420035
PubChem CID:	135110825
Reduced:	FSN2O3C15H23 (1)
Stoich.:	ABC2D3E15F23 (1)
Weight, g/mol:	387.170668
ΔH_f, kcal/mol:	-163.53
Dipole, Da:	4.99
IP(EA), eV:	-9.1(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(dimethylamino)-5-(4-fluoro-3-methoxyphenyl)-N-(3-pyrazol-1-ylpropyl)-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)CN2C[C@H]([C@H](C2)O)CS(=O)(=O)N(C)C)F

DOS

IR

Vibrations