Geometry & MOs

Info

ID:	181989
PubChem CID:	76823083
Reduced:	N4O8C27H42 (1)
Stoich.:	A4B8C27D42 (1)
Weight, g/mol:	270.072845
ΔH_f, kcal/mol:	-368.56
Dipole, Da:	7.39
IP(EA), eV:	-9.8(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-propan-2-ylimino-2-(trifluoromethyl)pyrido[3,2-d]pyrimidin-6-one

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)C)NC(=O)C(C)NC(=O)CNC(=O)C(CC1=CC=CC=C1)NC(=O)OCCOCCCO

DOS

IR

Vibrations