Geometry & MOs

Info

ID:	415954
PubChem CID:	135088956
Reduced:	O2N4C21H24 (1)
Stoich.:	A2B4C21D24 (1)
Weight, g/mol:	370.171499
ΔH_f, kcal/mol:	-15.29
Dipole, Da:	4.07
IP(EA), eV:	-9.27(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[[2-(2-methoxyphenyl)-1,3-thiazol-5-yl]methyl]-4-methyl-1-oxa-9-azaspiro[5.5]undec-4-ene

Drug info:

PubChemData

Smile

CCCC1=CC(=NN1)C(=O)N2C[C@H]([C@@H](C2)O)CC3=CC=NC4=CC=CC=C34

DOS

IR

Vibrations