Geometry & MOs

Info

ID:	140079
PubChem CID:	52643081
Reduced:	N3O3C21H37 (1)
Stoich.:	A3B3C21D37 (1)
Weight, g/mol:	392.07356
ΔH_f, kcal/mol:	-141.32
Dipole, Da:	2.94
IP(EA), eV:	-8.38(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromo-2-methylphenyl)-3-[(1S)-1-(2,5-dimethoxyphenyl)ethyl]urea

Drug info:

PubChemData

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CCN(CC)[C@H](CC(C)C)CNC(=O)N[C@H](C)C1=C(C=CC(=C1)OC)OC

DOS

IR

Vibrations