Geometry & MOs

Info

ID:	27057
PubChem CID:	813969
Reduced:	SO2N4C17H22 (1)
Stoich.:	AB2C4D17E22 (1)
Weight, g/mol:	341.173942
ΔH_f, kcal/mol:	-42.07
Dipole, Da:	6.45
IP(EA), eV:	-9.11(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2S)-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-phenyl-N-propan-2-ylcyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2=NN=C(S2)NC(=O)[C@H](C)NC(=O)C(C)(C)C

DOS

IR

Vibrations