Geometry & MOs

Info

ID:	347387
PubChem CID:	127272236
Reduced:	N2O2C19H26 (1)
Stoich.:	A2B2C19D26 (1)
Weight, g/mol:	302.199428
ΔH_f, kcal/mol:	-82.46
Dipole, Da:	2.77
IP(EA), eV:	-9.12(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C1CC2CCC1C2)NC(=O)N[C@@H]3[C@@H](CC4=CC=CC=C34)O

DOS

IR

Vibrations