Geometry & MOs

Info

ID:	359662
PubChem CID:	127299013
Reduced:	N4O4C17H28 (1)
Stoich.:	A4B4C17D28 (1)
Weight, g/mol:	356.151826
ΔH_f, kcal/mol:	-198.88
Dipole, Da:	5.57
IP(EA), eV:	-9.29(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dimethylpyrazol-1-yl)-N-[1-(1,1-dioxo-1,4-thiazinan-4-yl)-1-oxopropan-2-yl]propanamide

Drug info:

PubChemData

Smile

CC1(CN(CCO1)CCNC(=O)C2CCC3(CC2)C(=O)NC(=O)N3)C

DOS

IR

Vibrations