Geometry & MOs

Info

ID:	159741
PubChem CID:	57288689
Reduced:	N3O11C53H79 (1)
Stoich.:	A3B11C53D79 (1)
Weight, g/mol:	611.636902
ΔH_f, kcal/mol:	-466.84
Dipole, Da:	9.12
IP(EA), eV:	-7.65(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-phenylpropan-2-yl)tetratriacontan-17-amine

Drug info:

PubChemData

Smile

CCC1C=C(C(C(CC(C2C(CC(C(O2)(C(=O)C(=O)N3CCCCC3C(=O)OC(C(CCC1=O)C)C(=CC4CCC(C(C4)OC)N(C)C5=CC6=C(C=C5)N(C=C6)C)C)O)C)OC)OC)C)O)C

DOS

IR

Vibrations