Geometry & MOs

Info

ID:	346092
PubChem CID:	127270580
Reduced:	SO2N4C20H28 (1)
Stoich.:	AB2C4D20E28 (1)
Weight, g/mol:	365.24269
ΔH_f, kcal/mol:	-60.03
Dipole, Da:	3.8
IP(EA), eV:	-8.47(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1(CN(CCO1)CCNC(=O)N2CCCC2C3=NC4=CC=CC=C4S3)C

DOS

IR

Vibrations