Geometry & MOs

Info

ID:	183198
PubChem CID:	76990682
Reduced:	O2N3C10H21 (1)
Stoich.:	A2B3C10D21 (1)
Weight, g/mol:	221.133969
ΔH_f, kcal/mol:	-101.78
Dipole, Da:	4.75
IP(EA), eV:	-9.02(1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-amino-2-methylpropyl)-6-(difluoromethyl)-1,3-diazinan-4-one

Drug info:

PubChemData

Smile

CC(C)C(C1NC(CC(=O)N1)COC)N

DOS

IR

Vibrations