Geometry & MOs

Info

ID:	331336
PubChem CID:	127248743
Reduced:	O2N5C19H25 (1)
Stoich.:	A2B5C19D25 (1)
Weight, g/mol:	422.211804
ΔH_f, kcal/mol:	-21.6
Dipole, Da:	2.94
IP(EA), eV:	-8.5(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-[(2-fluorophenyl)methyl]morpholin-2-yl]-5-(4-methoxyphenyl)-N,N-dimethylpyrimidin-2-amine

Drug info:

PubChemData

Smile

CCN1CCOC(C1)C2=NC(=NC=C2C3=CC(=CC=C3)C(=O)N)N(C)C

DOS

IR

Vibrations