Geometry & MOs

Info

ID:	74997
PubChem CID:	48422837
Reduced:	O2N3C18H23 (1)
Stoich.:	A2B3C18D23 (1)
Weight, g/mol:	278.163043
ΔH_f, kcal/mol:	-11.22
Dipole, Da:	1.07
IP(EA), eV:	-9.55(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-1-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CC(C(=O)NCC1=CC=C(C=C1)CN2C=CC=N2)OCC3CC3

DOS

IR

Vibrations