Geometry & MOs

Info

ID:	414764
PubChem CID:	135087726
Reduced:	SN4O4C16H22 (1)
Stoich.:	AB4C4D16E22 (1)
Weight, g/mol:	347.16452
ΔH_f, kcal/mol:	-116.18
Dipole, Da:	9.15
IP(EA), eV:	-9.45(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclopropylmethyl)-3-(dimethylamino)-5-(4-fluoro-3-methoxyphenyl)-N-methyl-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CN1C=NC2=C1C=CC(=C2)C(=O)N[C@H]3COC[C@H]3CS(=O)(=O)N(C)C

DOS

IR

Vibrations