Geometry & MOs

Info

ID:	252839
PubChem CID:	103114512
Reduced:	N2O3C14H20 (1)
Stoich.:	A2B3C14D20 (1)
Weight, g/mol:	292.178693
ΔH_f, kcal/mol:	-49.09
Dipole, Da:	3.55
IP(EA), eV:	-9.43(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-2-methyl-N-[(2-methyl-3-nitrophenyl)methyl]oxan-4-amine

Drug info:

PubChemData

Smile

CC1CC(CCO1)NCC2=C(C(=CC=C2)[N+](=O)[O-])C

DOS

IR

Vibrations