Geometry & MOs

Info

ID:	195420
PubChem CID:	78684424
Reduced:	N3O4C23H29 (1)
Stoich.:	A3B4C23D29 (1)
Weight, g/mol:	397.200156
ΔH_f, kcal/mol:	-174.76
Dipole, Da:	0.87
IP(EA), eV:	-9.48(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-oxo-1-(propan-2-ylcarbamoylamino)propan-2-yl] 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylate

Drug info:

PubChemData

Smile

CC(C(=O)NC(=O)NC(C)(C)C)OC(=O)C1=C2CCCCCC2=NC3=CC=CC=C31

DOS

IR

Vibrations