Geometry & MOs

Info

ID:	238622
PubChem CID:	92763429
Reduced:	SN2C7H12 (1)
Stoich.:	AB2C7D12 (1)
Weight, g/mol:	212.225249
ΔH_f, kcal/mol:	17.07
Dipole, Da:	2.42
IP(EA), eV:	-8.97(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diethyl-2-[(3S)-3-methylazepan-1-yl]ethanamine

Drug info:

PubChemData

Smile

CC1=NC(=CS1)[C@@H](C)NC

DOS

IR

Vibrations