Geometry & MOs

Info

ID:	369902
PubChem CID:	127336739
Reduced:	N3O3C16H29 (1)
Stoich.:	A3B3C16D29 (1)
Weight, g/mol:	377.213698
ΔH_f, kcal/mol:	-141.98
Dipole, Da:	2.94
IP(EA), eV:	-8.98(0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropyl]-2,3-dimethyl-1-oxo-1,4-thiazinane-4-carboxamide

Drug info:

PubChemData

Smile

C1CC1N2CCC(CC2)NC(=O)NCC(C3CCOCC3)O

DOS

IR

Vibrations