Geometry & MOs

Info

ID:	208387
PubChem CID:	80526823
Reduced:	NSC18H31 (1)
Stoich.:	ABC18D31 (1)
Weight, g/mol:	261.129969
ΔH_f, kcal/mol:	-27.02
Dipole, Da:	1.12
IP(EA), eV:	-8.75(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[(2-methylpyrimidin-4-yl)methyl]-2-thiophen-2-ylpropan-1-amine

Drug info:

PubChemData

Smile

CC(C)(C)C1CCC(CC1)NCC(C)(C)C2=CC=CS2

DOS

IR

Vibrations