Geometry & MOs

Info

ID:	300114
PubChem CID:	119526869
Reduced:	FN3O3C18H20 (1)
Stoich.:	AB3C3D18E20 (1)
Weight, g/mol:	400.177837
ΔH_f, kcal/mol:	-61.38
Dipole, Da:	5.57
IP(EA), eV:	-9.28(-2.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide;hydrochloride

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)C(CNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])F)N

DOS

IR

Vibrations