Geometry & MOs

Info

ID:	186661
PubChem CID:	77464186
Reduced:	N2O7C31H34 (1)
Stoich.:	A2B7C31D34 (1)
Weight, g/mol:	436.182064
ΔH_f, kcal/mol:	-253.82
Dipole, Da:	4.13
IP(EA), eV:	-8.53(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9H-fluoren-9-ylmethyl N-(2,2-dimethyl-4-oxo-3,6,7,8,9,9a-hexahydropyrido[2,1-b][1,3]thiazin-3-yl)carbamate

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1OC(=O)OC(C)(C)CCO)C)COC(=O)N2C3=CC=CC=C3C(=CC4=C(C=C(N4)C)C)C2=O

DOS

IR

Vibrations