Geometry & MOs

Info

ID:	424323
PubChem CID:	135122198
Reduced:	F3H7C9 (1)
Stoich.:	A3B7C9 (1)
Weight, g/mol:	360.14337
ΔH_f, kcal/mol:	-115.18
Dipole, Da:	3.09
IP(EA), eV:	-9.92(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[5-(morpholine-4-carbonyl)-1H-indole-2-carbonyl]amino]ethylcarbamic acid

Drug info:

PubChemData

Smile

C=CC1=CC(=C(C=C1)C(F)F)F

DOS

IR

Vibrations