Geometry & MOs

Info

ID:	403734
PubChem CID:	135061634
Reduced:	O2C21H26 (1)
Stoich.:	A2B21C26 (1)
Weight, g/mol:	293.201774
ΔH_f, kcal/mol:	-47.67
Dipole, Da:	2.14
IP(EA), eV:	-9.32(0.16)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1,3-bis(2,6-dimethylphenyl)-5,6-dihydro-4H-pyrimidin-1-ium

Drug info:

PubChemData

Smile

CCC/C(=C\CCOCC1=CC=CC=C1)/C(C2=CC=CC=C2)O

DOS

IR

Vibrations