Geometry & MOs

Info

ID:	284593
PubChem CID:	104054543
Reduced:	NOC17H27 (1)
Stoich.:	ABC17D27 (1)
Weight, g/mol:	263.224915
ΔH_f, kcal/mol:	-57.45
Dipole, Da:	0.95
IP(EA), eV:	-8.32(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-methoxy-2,5-dimethylphenyl)-N-propylpentan-2-amine

Drug info:

PubChemData

Smile

CCCNC1CCC(C1)C2=C(C=C(C(=C2)C)OC)C

DOS

IR

Vibrations