Geometry & MOs

Info

ID:	431357
PubChem CID:	135171432
Reduced:	O5N6C32H36 (1)
Stoich.:	A5B6C32D36 (1)
Weight, g/mol:	141.15175
ΔH_f, kcal/mol:	-100.52
Dipole, Da:	5.88
IP(EA), eV:	-8.73(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-diethylcyclopentan-1-amine

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC(=O)C2=NC=C(C=C2)CNCCO)C3=C(C(=CC=C3)NC(=O)C4=NC=C(C=C4)CNCCO)OC

DOS

IR

Vibrations