Geometry & MOs

Info

ID:	249764
PubChem CID:	103091932
Reduced:	NOC19H31 (1)
Stoich.:	ABC19D31 (1)
Weight, g/mol:	205.146664
ΔH_f, kcal/mol:	-71.51
Dipole, Da:	1.92
IP(EA), eV:	-8.51(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-4-[4-(methoxymethyl)phenyl]-3-methylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CC(C(=CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)C)N

DOS

IR

Vibrations