Geometry & MOs

Info

ID:	448507
PubChem CID:	135291424
Reduced:	N4C9H14 (1)
Stoich.:	A4B9C14 (1)
Weight, g/mol:	182.178299
ΔH_f, kcal/mol:	29.09
Dipole, Da:	2.1
IP(EA), eV:	-8.95(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2S)-1-tert-butyl-2,5-dihydropyrrol-2-yl]-N-methylethanamine

Drug info:

PubChemData

Smile

CC1=NC(=C(C(=N1)N)N)C2CCC2

DOS

IR

Vibrations