Geometry & MOs

Info

ID:	18730
PubChem CID:	547027
Reduced:	O2N7C12H21 (1)
Stoich.:	A2B7C12D21 (1)
Weight, g/mol:	295.175673
ΔH_f, kcal/mol:	-83.82
Dipole, Da:	4.73
IP(EA), eV:	-9.64(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4,6-bis(propan-2-ylamino)-1,3,5-triazin-2-yl]carbamoyl]acetamide

Drug info:

PubChemData

Smile

CC(C)NC1=NC(=NC(=N1)NC(=O)NC(=O)C)NC(C)C

DOS

IR

Vibrations