Geometry & MOs

Info

ID:	302163
PubChem CID:	124349807
Reduced:	FO2N3C23H30 (1)
Stoich.:	AB2C3D23E30 (1)
Weight, g/mol:	384.150764
ΔH_f, kcal/mol:	-107.89
Dipole, Da:	4.31
IP(EA), eV:	-9.09(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(5S)-3-[(4-methoxyphenyl)methyl]-4,5-dihydro-1,2-oxazol-5-yl]methyl]-2-(4-methylsulfanylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1(C[C@H](C2=C(C1)N(N=C2)C3=CC=C(C=C3)F)NC(=O)[C@@H]4CCC[C@H](C4)OC)C

DOS

IR

Vibrations