Geometry & MOs

Info

ID:	57577
PubChem CID:	22425531
Reduced:	N3O5H17C19 (1)
Stoich.:	A3B5C17D19 (1)
Weight, g/mol:	337.142641
ΔH_f, kcal/mol:	-107.97
Dipole, Da:	2.98
IP(EA), eV:	-8.73(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(hydroxymethyl)-2-imino-8-methyl-N-[(4-methylphenyl)methyl]pyrano[2,3-c]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NC=C(C2=C1OC(=N)C(=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)CO

DOS

IR

Vibrations