Geometry & MOs

Info

ID:	159950
PubChem CID:	57299216
Reduced:	N2O2C14H17 (2)
Stoich.:	A2B2C14D17 (2)
Weight, g/mol:	135.045092
ΔH_f, kcal/mol:	-103.5
Dipole, Da:	5.79
IP(EA), eV:	-9.51(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-chloroethyl)propanamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N1CCC(CC1)CC(=O)O)NCC(C=CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)C(=N)N

DOS

IR

Vibrations