Geometry & MOs

Info

ID:	420861
PubChem CID:	135114937
Reduced:	O3N5C16H19 (1)
Stoich.:	A3B5C16D19 (1)
Weight, g/mol:	318.184447
ΔH_f, kcal/mol:	-58.68
Dipole, Da:	4.84
IP(EA), eV:	-9.73(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[(4-methyl-6-phenylpyrimidin-2-yl)methyl]-2-pyridin-2-ylethanamine

Drug info:

PubChemData

Smile

C1C(CN2C(=CC(=N2)C(=O)NCCCC3=CC=CC=N3)C(=O)N1)O

DOS

IR

Vibrations