Geometry & MOs

Info

ID:	303292
PubChem CID:	124489469
Reduced:	SN2O2C14H16 (1)
Stoich.:	AB2C2D14E16 (1)
Weight, g/mol:	303.104148
ΔH_f, kcal/mol:	-17.07
Dipole, Da:	2.19
IP(EA), eV:	-8.72(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(1S)-1-[(4-methyl-1,3-thiazol-5-yl)methylamino]ethyl]-4H-1,4-benzoxazin-3-one

Drug info:

PubChemData

Smile

CC1=C(SC=N1)CN[C@H](C)C2=CC3=C(C=C2)OCO3

DOS

IR

Vibrations