Geometry & MOs

Info

ID:	365378
PubChem CID:	127317777
Reduced:	SO2N3C19H29 (1)
Stoich.:	AB2C3D19E29 (1)
Weight, g/mol:	337.18017
ΔH_f, kcal/mol:	-87.09
Dipole, Da:	3.56
IP(EA), eV:	-8.48(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-fluoro-5-morpholin-4-ylphenyl)-3-[(3-methyloxolan-3-yl)methyl]urea

Drug info:

PubChemData

Smile

CC1(CCOC1)CNC(=O)NC2=CC=C(C=C2)CCN3CCSCC3

DOS

IR

Vibrations