Geometry & MOs

Info

ID:	252924
PubChem CID:	103114959
Reduced:	N2O3C14H20 (1)
Stoich.:	A2B3C14D20 (1)
Weight, g/mol:	296.173607
ΔH_f, kcal/mol:	-55.93
Dipole, Da:	6.12
IP(EA), eV:	-9.52(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3-diethoxy-N-[(2-methyl-3-nitrophenyl)methyl]propan-1-amine

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1[N+](=O)[O-])CN[C@H]2CCCC[C@@H]2O

DOS

IR

Vibrations