Geometry & MOs

Info

ID:	433037
PubChem CID:	135173174
Reduced:	ON6C29H34 (1)
Stoich.:	AB6C29D34 (1)
Weight, g/mol:	188.131349
ΔH_f, kcal/mol:	57.94
Dipole, Da:	4.46
IP(EA), eV:	-8.33(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,5-dimethylphenyl)-3,4-dihydro-2H-pyrrol-5-amine

Drug info:

PubChemData

Smile

CCCC1CNCCC(N1C2=NC=C(C=N2)C3=CC4=C(C=C3)N=C5N4[C@H](COC5)C6=CC=CC=C6)C

DOS

IR

Vibrations