Geometry & MOs

Info

ID:	155132
PubChem CID:	56320733
Reduced:	N3O5C23H29 (1)
Stoich.:	A3B5C23D29 (1)
Weight, g/mol:	406.131091
ΔH_f, kcal/mol:	-190.66
Dipole, Da:	4.89
IP(EA), eV:	-9.11(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-N-[3-[[2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]sulfanylacetyl]amino]propyl]benzamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NCCCNC(=O)C1=CC(=CC=C1)O)NC(=O)C2=CC=C(C=C2)OC

DOS

IR

Vibrations