Geometry & MOs

Info

ID:	272440
PubChem CID:	103743085
Reduced:	ClO2N3C12H18 (1)
Stoich.:	AB2C3D12E18 (1)
Weight, g/mol:	265.142641
ΔH_f, kcal/mol:	-70.98
Dipole, Da:	6.89
IP(EA), eV:	-8.87(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-[(4-methyloxan-4-yl)methyl]-5-nitropyridin-2-amine

Drug info:

PubChemData

Smile

CC1(CCOCC1)CNC2=C(C(=O)N(N=C2)C)Cl

DOS

IR

Vibrations