Geometry & MOs

Info

ID:	347393
PubChem CID:	127272242
Reduced:	O2N3C20H31 (1)
Stoich.:	A2B3C20D31 (1)
Weight, g/mol:	347.220892
ΔH_f, kcal/mol:	-89.36
Dipole, Da:	5.48
IP(EA), eV:	-8.85(0.02)
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-[[4-(2-methylpropyl)morpholin-2-yl]methyl]urea

Drug info:

PubChemData

Smile

CN(C)C1(CCCCCC1)CNC(=O)N[C@@H]2[C@@H](CC3=CC=CC=C23)O

DOS

IR

Vibrations