Geometry & MOs

Info

ID:	210356
PubChem CID:	80796107
Reduced:	N5C16H31 (1)
Stoich.:	A5B16C31 (1)
Weight, g/mol:	304.135782
ΔH_f, kcal/mol:	-1.18
Dipole, Da:	4.84
IP(EA), eV:	-8.25(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-N-ethyl-4-N-(4-methoxyphenyl)-4-N-methyl-2-methylsulfanylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCCNC1=NC=C(C(=N1)NCCCCN(C)C(C)C)C

DOS

IR

Vibrations