Geometry & MOs

Info

ID:	288548
PubChem CID:	104319324
Reduced:	O2N3C16H23 (1)
Stoich.:	A2B3C16D23 (1)
Weight, g/mol:	260.152478
ΔH_f, kcal/mol:	-75.71
Dipole, Da:	7.0
IP(EA), eV:	-8.4(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-amino-4-methylphenyl)-(4-hydroxy-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)methanone

Drug info:

PubChemData

Smile

CN(C)C1=C(C=C(C=C1)C(=O)N2CC3CCC(C3C2)O)N

DOS

IR

Vibrations