Geometry & MOs

Info

ID:	152625
PubChem CID:	56311618
Reduced:	N3O3C23H35 (1)
Stoich.:	A3B3C23D35 (1)
Weight, g/mol:	429.181919
ΔH_f, kcal/mol:	-140.32
Dipole, Da:	4.43
IP(EA), eV:	-8.31(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[(3-chlorophenyl)methylamino]-2-oxoethyl]-N-pentan-3-yl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Drug info:

PubChemData

Smile

CCC1CCCCN1C(=O)CN2CC(OC3=CC=CC=C32)C(=O)NC(CC)CC

DOS

IR

Vibrations