Geometry & MOs

Info

ID:	305937
PubChem CID:	124975192
Reduced:	ON7C17H23 (1)
Stoich.:	AB7C17D23 (1)
Weight, g/mol:	354.205576
ΔH_f, kcal/mol:	25.18
Dipole, Da:	6.3
IP(EA), eV:	-8.99(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(methoxymethyl)-N-[[2-methyl-4-[(2R)-1-methylpyrrolidin-2-yl]pyrimidin-5-yl]methyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)NC2=NC=CN=C2[C@@H]3CCCN3CC(=O)NC)C

DOS

IR

Vibrations