Geometry & MOs

Info

ID:	356552
PubChem CID:	127291774
Reduced:	O3N4C20H32 (1)
Stoich.:	A3B4C20D32 (1)
Weight, g/mol:	397.236542
ΔH_f, kcal/mol:	-136.11
Dipole, Da:	1.32
IP(EA), eV:	-9.02(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(OC(=N1)CN2CCN(CC2)C(=O)C(C)NC(=O)C3CCCCC3)C

DOS

IR

Vibrations