Geometry & MOs

Info

ID:	336439
PubChem CID:	127255446
Reduced:	ClO5N6C23H33 (1)
Stoich.:	AB5C6D23E33 (1)
Weight, g/mol:	164.108026
ΔH_f, kcal/mol:	-222.85
Dipole, Da:	5.08
IP(EA), eV:	-9.45(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-propan-2-ylpyrrolidin-3-amine;hydrochloride

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N[C@H](CCC(=O)N)C(=O)N[C@@H](CCCCN)C(=O)N)NC(=O)/C=C/C1=CC=C(C=C1)Cl

DOS

IR

Vibrations