Geometry & MOs

Info

ID:	158589
PubChem CID:	56464250
Reduced:	OSN4C22H28 (1)
Stoich.:	ABC4D22E28 (1)
Weight, g/mol:	401.213698
ΔH_f, kcal/mol:	-1.13
Dipole, Da:	4.94
IP(EA), eV:	-8.95(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-2-(2-methylpropyl)-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)CC(C)C)C(=O)NC2=CC=CC(=C2)CN3C=CN=C3C(C)C

DOS

IR

Vibrations