Geometry & MOs

Info

ID:	270940
PubChem CID:	103638869
Reduced:	N2O3C16H16 (1)
Stoich.:	A2B3C16D16 (1)
Weight, g/mol:	206.105528
ΔH_f, kcal/mol:	-85.48
Dipole, Da:	3.02
IP(EA), eV:	-9.51(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations