Geometry & MOs

Info

ID:	285518
PubChem CID:	104109964
Reduced:	ClN4C12H23 (1)
Stoich.:	AB4C12D23 (1)
Weight, g/mol:	205.123342
ΔH_f, kcal/mol:	-5.62
Dipole, Da:	3.81
IP(EA), eV:	-9.45(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-(oxolan-3-ylmethyl)pentan-2-amine

Drug info:

PubChemData

Smile

CC(C)CN1C(=NC=N1)CNC(C)CC(C)Cl

DOS

IR

Vibrations