Geometry & MOs

Info

ID:	347382
PubChem CID:	127272231
Reduced:	O2N3C22H27 (1)
Stoich.:	A2B3C22D27 (1)
Weight, g/mol:	365.173942
ΔH_f, kcal/mol:	-55.01
Dipole, Da:	5.62
IP(EA), eV:	-8.67(-0.11)
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-[3-(pyrrolidine-1-carbonyl)phenyl]urea

Drug info:

PubChemData

Smile

C1CCCN(CC1)C2=CC=CC=C2NC(=O)N[C@@H]3[C@@H](CC4=CC=CC=C34)O

DOS

IR

Vibrations