Geometry & MOs

Info

ID:	421987
PubChem CID:	135116969
Reduced:	S2N4O5C12H22 (1)
Stoich.:	A2B4C5D12E22 (1)
Weight, g/mol:	383.184506
ΔH_f, kcal/mol:	-182.31
Dipole, Da:	8.96
IP(EA), eV:	-9.42(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-cyclopropylmorpholin-4-yl)-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone

Drug info:

PubChemData

Smile

CCC1=NC=C(N1)S(=O)(=O)N[C@H]2COC[C@H]2CS(=O)(=O)N(C)C

DOS

IR

Vibrations