Geometry & MOs

Info

ID:	271146
PubChem CID:	103645262
Reduced:	N2O2F3C9H13 (1)
Stoich.:	A2B2C3D9E13 (1)
Weight, g/mol:	316.189926
ΔH_f, kcal/mol:	-227.74
Dipole, Da:	4.21
IP(EA), eV:	-10.18(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[3-[(3-methylquinoxalin-2-yl)amino]propyl]carbamate

Drug info:

PubChemData

Smile

CC(CC#N)N(C)C(=O)COCC(F)(F)F

DOS

IR

Vibrations