Geometry & MOs

Info

ID:	415669
PubChem CID:	135088668
Reduced:	FN4C21H27 (1)
Stoich.:	AB4C21D27 (1)
Weight, g/mol:	327.125277
ΔH_f, kcal/mol:	-4.13
Dipole, Da:	1.59
IP(EA), eV:	-8.5(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-amino-1,3-thiazol-4-yl)-[(4R,5S)-4,5-dihydroxy-4-methyl-1-oxa-9-azaspiro[5.5]undecan-9-yl]methanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)F)CN2CCCC3(C2)CCC4=CN=C(N=C34)N(C)C

DOS

IR

Vibrations