Geometry & MOs

Info

ID:	437473
PubChem CID:	135226398
Reduced:	FO4N9C30H32 (1)
Stoich.:	AB4C9D30E32 (1)
Weight, g/mol:	219.071785
ΔH_f, kcal/mol:	-17.52
Dipole, Da:	6.32
IP(EA), eV:	-8.96(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-4-(phenylmethoxymethyl)-1,3-thiazole

Drug info:

PubChemData

Smile

CC1=C(N(N=C1C2=CC3=C(N=C2)N(N=C3CO)C)C4=CC=CC=C4)NC(=O)N[C@@H]5CN(O[C@H]5C6=CC(=NC=C6)F)CCOC

DOS

IR

Vibrations