Geometry & MOs

Info

ID:	214308
PubChem CID:	84975033
Reduced:	O2N3C16H24 (1)
Stoich.:	A2B3C16D24 (1)
Weight, g/mol:	362.199428
ΔH_f, kcal/mol:	-66.72
Dipole, Da:	1.97
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.757771
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(dimethylamino)phenyl]methyl]-2-(6-methoxynaphthalen-2-yl)propanamide

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1NC(=O)C[NH+]2CCCC(C2)C(=O)N

DOS

IR

Vibrations