Geometry & MOs

Info

ID:	445998
PubChem CID:	135271248
Reduced:	NOC13H13 (2)
Stoich.:	ABC13D13 (2)
Weight, g/mol:	355.381415
ΔH_f, kcal/mol:	8.17
Dipole, Da:	1.21
IP(EA), eV:	-8.0(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dimethyl-4-(8-methylpentadecan-8-ylamino)pentan-2-ol

Drug info:

PubChemData

Smile

C=CC(=O)N1CC(C1)C2=CC3=C(CN(CCC3)C4=CC(=CC5=CC=CC=C54)O)C=C2

DOS

IR

Vibrations