Geometry & MOs

Info

ID:	245504
PubChem CID:	99445278
Reduced:	BrN2O3C17H23 (1)
Stoich.:	AB2C3D17E23 (1)
Weight, g/mol:	379.229348
ΔH_f, kcal/mol:	-117.41
Dipole, Da:	8.53
IP(EA), eV:	-8.89(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R)-4-methyl-2-morpholin-4-ylpentyl]-3-[2-(4-methylphenyl)sulfanylethyl]urea

Drug info:

PubChemData

Smile

CCN([C@H](C)COC)C(=O)[C@H]1CC(=O)N(C1)C2=CC(=CC=C2)Br

DOS

IR

Vibrations