Geometry & MOs

Info

ID:	197152
PubChem CID:	78929435
Reduced:	O2N6C13H22 (1)
Stoich.:	A2B6C13D22 (1)
Weight, g/mol:	213.184112
ΔH_f, kcal/mol:	-50.53
Dipole, Da:	2.47
IP(EA), eV:	-8.93(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]propanamide

Drug info:

PubChemData

Smile

CN(C)C1=NC(=NC(=N1)N)CN2CCCC(C2)C(=O)OC

DOS

IR

Vibrations