Geometry & MOs

Info

ID:	312150
PubChem CID:	126603363
Reduced:	NF3C18H28 (1)
Stoich.:	AB3C18D28 (1)
Weight, g/mol:	291.256215
ΔH_f, kcal/mol:	-182.23
Dipole, Da:	3.28
IP(EA), eV:	-9.24(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,3-ditert-butylphenyl)-2-methoxybutan-1-amine

Drug info:

PubChemData

Smile

CC(C)C1=C(C(=CC=C1)C(CCCN)C(F)(F)F)C(C)(C)C

DOS

IR

Vibrations