Geometry & MOs

Info

ID:	300109
PubChem CID:	119526851
Reduced:	ON6C19H24 (1)
Stoich.:	AB6C19D24 (1)
Weight, g/mol:	354.131047
ΔH_f, kcal/mol:	38.18
Dipole, Da:	3.48
IP(EA), eV:	-9.29(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-3,4-difluorobenzamide;hydrochloride

Drug info:

PubChemData

Smile

CC1=CC(=NC2=NC(=NN12)C(=O)NCC(C3=CC=C(C=C3)C(C)C)N)C

DOS

IR

Vibrations