Geometry & MOs

Info

ID:	347436
PubChem CID:	127272285
Reduced:	N2O3C17H24 (1)
Stoich.:	A2B3C17D24 (1)
Weight, g/mol:	302.199428
ΔH_f, kcal/mol:	-126.89
Dipole, Da:	4.47
IP(EA), eV:	-9.24(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethylcyclohexyl)-3-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]urea

Drug info:

PubChemData

Smile

C1CCC(C1)OCCNC(=O)N[C@@H]2[C@@H](CC3=CC=CC=C23)O

DOS

IR

Vibrations