Geometry & MOs

Info

ID:	230149
PubChem CID:	87570301
Reduced:	OC4H6 (2)
Stoich.:	AB4C6 (2)
Weight, g/mol:	310.117824
ΔH_f, kcal/mol:	-69.09
Dipole, Da:	4.95
IP(EA), eV:	-10.25(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(2-amino-4-ethoxypteridin-6-yl)phenyl]formamide

Drug info:

PubChemData

Smile

CC/C=C/C1(CC1)C(=O)O

DOS

IR

Vibrations