Geometry & MOs

Info

ID:	196119
PubChem CID:	78784531
Reduced:	NOF3C15H16 (1)
Stoich.:	ABC3D15E16 (1)
Weight, g/mol:	274.179361
ΔH_f, kcal/mol:	-169.83
Dipole, Da:	7.09
IP(EA), eV:	-9.54(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-N,N-dipropylbenzotriazole-5-carboxamide

Drug info:

PubChemData

Smile

CC=CC=CC(=O)NCCC1=CC=C(C=C1)C(F)(F)F

DOS

IR

Vibrations