Geometry & MOs

Info

ID:	281878
PubChem CID:	103914489
Reduced:	N2O3C16H26 (1)
Stoich.:	A2B3C16D26 (1)
Weight, g/mol:	251.188529
ΔH_f, kcal/mol:	-150.75
Dipole, Da:	3.91
IP(EA), eV:	-8.67(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[(2-hydroxy-4-methylpentyl)amino]propyl]phenol

Drug info:

PubChemData

Smile

CCC(C1=CC=CC=C1O)NCCNC(=O)OC(C)(C)C

DOS

IR

Vibrations