Geometry & MOs

Info

ID:	195419
PubChem CID:	78684171
Reduced:	N3O5C18H23 (1)
Stoich.:	A3B5C18D23 (1)
Weight, g/mol:	411.215806
ΔH_f, kcal/mol:	-182.25
Dipole, Da:	6.38
IP(EA), eV:	-8.83(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(tert-butylcarbamoylamino)-1-oxopropan-2-yl] 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=C(N1C)C)C(=O)COC(=O)CN2C(=O)C(NC2=O)(C)C3CC3

DOS

IR

Vibrations