Geometry & MOs

Info

ID:	77351
PubChem CID:	48426227
Reduced:	FN2O3C16H19 (1)
Stoich.:	AB2C3D16E19 (1)
Weight, g/mol:	303.169525
ΔH_f, kcal/mol:	-141.2
Dipole, Da:	2.6
IP(EA), eV:	-9.23(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-1-ethylbenzotriazole-5-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1=C(C2=C(O1)C(=CC=C2)F)C

DOS

IR

Vibrations