Geometry & MOs

Info

ID:	313177
PubChem CID:	126612374
Reduced:	O4C21H26 (1)
Stoich.:	A4B21C26 (1)
Weight, g/mol:	370.192629
ΔH_f, kcal/mol:	-153.02
Dipole, Da:	5.03
IP(EA), eV:	-8.43(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[1-methoxy-4-methyl-3-[[(3S)-3-methylpentanoyl]amino]pentyl]-1,3-thiazole-4-carboxylate

Drug info:

PubChemData

Smile

CCCCOC1=C(C=C(C=C1)C(=O)OCCOC2=CC=C(C=C2)C)C

DOS

IR

Vibrations