Geometry & MOs

Info

ID:	273968
PubChem CID:	103806156
Reduced:	O2N3C10H17 (1)
Stoich.:	A2B3C10D17 (1)
Weight, g/mol:	250.168128
ΔH_f, kcal/mol:	-92.53
Dipole, Da:	8.26
IP(EA), eV:	-9.69(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(2-aminoethyl)phenyl]methyl]-2-propoxyacetamide

Drug info:

PubChemData

Smile

C1CC(=O)N[C@H]1C(=O)N2CCC(C2)CN

DOS

IR

Vibrations