Geometry & MOs

Info

ID:	247432
PubChem CID:	103071370
Reduced:	ON2C13H26 (1)
Stoich.:	AB2C13D26 (1)
Weight, g/mol:	254.235814
ΔH_f, kcal/mol:	-49.5
Dipole, Da:	2.3
IP(EA), eV:	-8.61(1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[2-[(tert-butylamino)methyl]prop-2-enyl]azepan-2-yl]methanol

Drug info:

PubChemData

Smile

CCNCC(=C)CN1CCCCCC1CO

DOS

IR

Vibrations