Geometry & MOs

Info

ID:	155096
PubChem CID:	56320682
Reduced:	N4O4C23H28 (1)
Stoich.:	A4B4C23D28 (1)
Weight, g/mol:	414.136176
ΔH_f, kcal/mol:	-143.52
Dipole, Da:	3.34
IP(EA), eV:	-8.94(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]sulfanyl-N-[2-[2-(4-methylphenyl)-1,3-oxazol-4-yl]ethyl]acetamide

Drug info:

PubChemData

Smile

CC1CCC2(CC1)C(=O)N(C(=O)N2)CC(=O)NCCC3=COC(=N3)C4=CC=C(C=C4)C

DOS

IR

Vibrations