Geometry & MOs

Info

ID:	210560
PubChem CID:	80822900
Reduced:	N5C14H15 (1)
Stoich.:	A5B14C15 (1)
Weight, g/mol:	368.04188
ΔH_f, kcal/mol:	97.6
Dipole, Da:	4.51
IP(EA), eV:	-8.73(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-[(5-bromothiophen-2-yl)methyl]-4-N-methyl-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

CC1=CN=C(N=C1N(C)C2=CC=CC(=C2)C#N)NC

DOS

IR

Vibrations