Geometry & MOs

Info

ID:	294920
PubChem CID:	117505320
Reduced:	NC7H9 (3)
Stoich.:	AB7C9 (3)
Weight, g/mol:	321.17625
ΔH_f, kcal/mol:	36.83
Dipole, Da:	3.05
IP(EA), eV:	-8.01(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[3-methoxy-2-(thian-3-yloxy)phenyl]cyclopentyl]methanamine

Drug info:

PubChemData

Smile

CC(C)N1C2=C(C=C(C=C2)CCN3CCNCC3)C4=CC=CC=C41

DOS

IR

Vibrations