Geometry & MOs

Info

ID:	376432
PubChem CID:	134222445
Reduced:	FON2C19H21 (1)
Stoich.:	ABC2D19E21 (1)
Weight, g/mol:	310.153307
ΔH_f, kcal/mol:	-22.09
Dipole, Da:	6.17
IP(EA), eV:	-9.35(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tert-butyl-7-[(3,4-difluorophenyl)methyl]naphthalene

Drug info:

PubChemData

Smile

CC(CC1=C2C(=CC(=C1)C(C)(C)C)C=CN=N2)C3=CC(=CO3)F

DOS

IR

Vibrations