Geometry & MOs

Info

ID:	356559
PubChem CID:	127291785
Reduced:	SO2N5C19H29 (1)
Stoich.:	AB2C5D19E29 (1)
Weight, g/mol:	362.231791
ΔH_f, kcal/mol:	-46.77
Dipole, Da:	1.26
IP(EA), eV:	-8.24(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentyl-N-[2-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]-2-oxoethyl]acetamide

Drug info:

PubChemData

Smile

CC1=C(OC(=N1)CN2CCN(CC2)C(=O)CSC3=NC=CN3C(C)(C)C)C

DOS

IR

Vibrations