Geometry & MOs

Info

ID:	358577
PubChem CID:	127296336
Reduced:	ON2C14H20 (1)
Stoich.:	AB2C14D20 (1)
Weight, g/mol:	397.236542
ΔH_f, kcal/mol:	-41.79
Dipole, Da:	4.51
IP(EA), eV:	-9.33(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(3-methoxy-4-methylphenyl)cyclopentyl]-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1CC(CN(C1)C(=O)C2=C(N=CC=C2)C)C

DOS

IR

Vibrations