Geometry & MOs

Info

ID:	207760
PubChem CID:	80445823
Reduced:	ON6C13H22 (1)
Stoich.:	AB6C13D22 (1)
Weight, g/mol:	235.193614
ΔH_f, kcal/mol:	26.25
Dipole, Da:	2.66
IP(EA), eV:	-8.9(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,3-dimethyl-1-(2-propan-2-ylphenoxy)butan-2-amine

Drug info:

PubChemData

Smile

CCC(C)C(CN1C(=O)C2=C(N=N1)N(N=C2)C)NCC

DOS

IR

Vibrations