Geometry & MOs

Info

ID:	240737
PubChem CID:	93617236
Reduced:	N3O3C18H23 (1)
Stoich.:	A3B3C18D23 (1)
Weight, g/mol:	279.158292
ΔH_f, kcal/mol:	-16.66
Dipole, Da:	1.66
IP(EA), eV:	-8.97(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[cyclopropyl-[[(3S)-oxolan-3-yl]methyl]amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=NOC(=N2)CN(C[C@@H]3CCOC3)C4CC4

DOS

IR

Vibrations