Geometry & MOs

Info

ID:	156356
PubChem CID:	56370249
Reduced:	N3O5C22H27 (1)
Stoich.:	A3B5C22D27 (1)
Weight, g/mol:	416.184841
ΔH_f, kcal/mol:	-196.69
Dipole, Da:	4.38
IP(EA), eV:	-8.21(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-3-[2-methyl-5-(phenylcarbamoylamino)phenyl]urea

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1=C(C=CC(=C1)NC(=O)N[C@H]2[C@H](CC3=CC=CC=C23)O)OC

DOS

IR

Vibrations